SCHEMBL25565848

SCHEMBL25565848

Cc1ccccc1-n1ccc(=O)[nH]c1=O

nearest known ligand 0.56

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 4/20 0.56
DDB1 Q16531 2/20 0.56
HCAR1 Q9BXC0 6/20 0.54
ALDH1A1 P00352 2/20 0.46
MGLL Q99685 1/20 0.44
KMT2A Q03164 2/20 0.43
ALOX5 P09917 1/20 0.41
MAPT P10636 2/20 0.41
MEN1 O00255 1/20 0.41
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL11242299 0.79 CRBN (0.53) CRBNDDB1HCAR1ALDH1A1KMT2A
SCHEMBL6557227 0.78 CRBN (0.56) CRBNDDB1HCAR1ALDH1A1POLB
SCHEMBL10980130 0.78 ALDH1A1 (0.64) CRBNDDB1HCAR1ALDH1A1MGLL
SCHEMBL2709043 0.78 CRBN (0.56) CRBNDDB1HCAR1ALDH1A1KMT2A
SCHEMBL8018395 0.78 CRBN (0.56) CRBNDDB1HCAR1ALDH1A1MGLL
SCHEMBL6406005 0.78 CRBN (0.56) CRBNDDB1HCAR1
SCHEMBL23121407 0.76 ESR1 (0.46) CRBNDDB1HCAR1ALDH1A1MAPT
SCHEMBL7457109 0.74 CRBN (0.51) CRBNDDB1KMT2AMAPTMEN1
SCHEMBL23121039 0.74 HTR3E (0.47) CRBNDDB1HCAR1ALDH1A1KMT2A
SCHEMBL7977829 0.73 CRBN (0.50) CRBNDDB1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118598875-A Pyrimidine diketone amide compound and preparation method and application thereof 广州医科大学 2024-09-06 CN disclosed
WO-2023096995-A1 COMPOSITIONS AND METHODS COMPRISING SUBSTITUTED N-(2-CHLORO-6-METHYLPHENYL)-2-((6-(6-MEMBERED HETEROCYCLOALKYL)-2-METHYLPYRIMIDIN-4-YL)AMINO)THIAZOLE-5-CARBOXAMIDE ANALOGUES ST. JUDE CHILDREN'S RESEARCH HOSPITAL, INC. (US) 2023-06-01 WO disclosed
CN-114605408-A 5-hydroxy-1, 3-disubstituted phenyl pyrido [2,3-d ] pyrimidine compound and preparation method and application thereof 沈阳药科大学 2022-06-10 CN disclosed